Simeconazole
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000073
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA000073 contains the MS2 mass spectrum of Simeconazole with the InChIkey YABFPHSQTSFWQB-UHFFFAOYSA-N.
Source: Simeconazole
Chemical Info
| InChI | InChI=1S/C14H20FN3OSi/c1-20(2,3)9-14(19,8-18-11-16-10-17-18)12-4-6-13(15)7-5-12/h4-7,10-11,19H,8-9H2,1-3H3 |
|---|---|
| SMILES | Fc(c2)ccc(c2)C(O)(Cn(c1)ncn1)C[Si](C)(C)C |
| InChI Key | YABFPHSQTSFWQB-UHFFFAOYSA-N |
| Molecular Formula | C14H20FN3OSi |
| Exact Mass | 293.136 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | d110c422-4ee1-40ff-b38b-e1da7286e216 |
| Package id | msbnk-waters-wa000073 |
| Resource type | HTML |
| State | active |